Structure of PDB 2cw3 Chain B Binding Site BS01

Receptor Information
>2cw3 Chain B (length=196) Species: 31276 (Perkinsus marinus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LRMTLPYGLEALEPVISAATVDFHYNKHHQGYIQKLLDATGLPESRINLK
SLVTLGPDRAGENVFNAAGQIYNHNMYWLSMVPTSGSGRHVPPRLLKLIR
ARWGNVDEMKENFMRKATALFGSGWIWLVWDTRERRLDLVGTKDAHSPLS
EDAGKIPLFTCDVWEHAYYLDYQHDRAAYLTRWWSLINWEFADSNL
Ligand information
Ligand IDFE
InChIInChI=1S/Fe/q+3
InChIKeyVTLYFUHAOXGGBS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0		[Fe+3]
FormulaFe
NameFE (III) ION
ChEMBL
DrugBankDB13949
ZINC
PDB chain2cw3 Chain B Residue 539 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2cw3 Structures of PmSOD1 and PmSOD2, two superoxide dismutases from the protozoan parasite Perkinsus marinus
Resolution2.5 Å
Binding residue
(original residue number in PDB)		H31 H81 D169 H173
Binding residue
(residue number reindexed from 1)		H24 H74 D162 H166
Annotation score1
Enzymatic activity
Enzyme Commision number 1.15.1.1: superoxide dismutase.
Gene Ontology
Molecular Function
GO:0004784 superoxide dismutase activity
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding
Biological Process
GO:0006801 superoxide metabolic process
GO:0019430 removal of superoxide radicals
Cellular Component
GO:0016020 membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:2cw3, PDBe:2cw3, PDBj:2cw3
PDBsum2cw3
PubMed17077482
UniProtQ8ISI9

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